SCHEMBL28699460

SCHEMBL28699460

CCC(=O)Oc1ccc(C)cc1-c1cccc2[nH]nnc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 2/20 0.39
GABRB3 P28472 2/20 0.39
GABRA2 P47869 2/20 0.39
ACHE P22303 3/20 0.37
PDGFRB P09619 1/20 0.36
PDGFRA P16234 1/20 0.36
ALOX15 P16050 1/20 0.34
TP53 P04637 2/20 0.34
MAPT P10636 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9741459 0.87 SMN1; SMN2 (0.41) GABRG2GABRB3GABRA2TP53MAPT
SCHEMBL5585189 0.84 GABRG2 (0.35) GABRG2GABRB3GABRA2MAPTSMN1; SMN2
SCHEMBL27868049 0.83 TYMS (0.37) GABRG2GABRB3GABRA2MAPTPTGDR2
SCHEMBL30442196 0.80 ACHE (0.39) GABRG2GABRB3GABRA2ACHEPDGFRB
SCHEMBL28855448 0.76 KMT2A (0.41) ACHEPDGFRBPDGFRAALOX15TP53
SCHEMBL30159199 0.76 KMT2A (0.41) ACHEPDGFRBPDGFRAALOX15TP53
SCHEMBL11222168 0.76 PARP1 (0.36) GABRG2GABRB3GABRA2TP53MAPT
SCHEMBL31570214 0.75 HPGD (0.44) ALOX15TP53MAPTSMN1; SMN2L3MBTL1
SCHEMBL29410659 0.75 HPGD (0.44) ALOX15TP53MAPTSMN1; SMN2L3MBTL1
SCHEMBL456767 0.75 HPGD (0.44) ALOX15TP53MAPTSMN1; SMN2L3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114213732-B Modified master batch for enhancing weatherability of polyethylene winding pipe and preparation method thereof 公元管道(安徽)有限公司 2023-05-12 CN claimed
CN-114213732-A Modified master batch for enhancing weather resistance of polyethylene winding pipe and preparation method thereof 安徽永高塑业发展有限公司 2022-03-22 CN claimed
CN-116675974-A Polycarbonate composition, polycarbonate material, secondary battery, and electric device 宁德时代新能源科技股份有限公司 2023-09-01 CN disclosed
CN-114213732-B Modified master batch for enhancing weatherability of polyethylene winding pipe and preparation method thereof 公元管道(安徽)有限公司 2023-05-12 CN disclosed
CN-114213732-B Modified master batch for enhancing weatherability of polyethylene winding pipe and preparation method thereof 公元管道(安徽)有限公司 2023-05-12 CN disclosed
CN-114213732-A Modified master batch for enhancing weather resistance of polyethylene winding pipe and preparation method thereof 安徽永高塑业发展有限公司 2022-03-22 CN disclosed
CN-114213732-A Modified master batch for enhancing weather resistance of polyethylene winding pipe and preparation method thereof 安徽永高塑业发展有限公司 2022-03-22 CN disclosed